SCHEMBL8000086

SCHEMBL8000086

CC[N]Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.43
▸ TSHR P16473 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ NT5E P21589 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MIF P14174 1/20 0.40
▸ CA2 P00918 7/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ PSIP1 O75475 1/20 0.37
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ CA1 P00915 2/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA4 P22748 1/20 0.34
▸ CA6 P23280 1/20 0.34
▸ CA5A P35218 1/20 0.34
▸ CA7 P43166 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7582804 0.80 LMNA (0.46) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL3919570 0.79 TSHR (0.44) LMNATSHRALDH1A1SMN1; SMN2TDP1
SCHEMBL1563242 0.77 CA2 (0.61) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL93796 0.77 CA2 (0.61) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL20080951 0.76 LMNA (0.46) LMNATSHRALDH1A1NT5ESMN1; SMN2
Ammonia Solution, Strong SCHEMBL28149524 0.75 CA2 (0.59) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1589664 0.75 CA2 (0.59) LMNATSHRALDH1A1NT5ESMN1; SMN2
Hydrochloric Acid SCHEMBL27699249 0.75 CA2 (0.59) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL14862486 0.75 CA2 (0.59) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1589452 0.75 CA2 (0.59) LMNATSHRALDH1A1NT5ESMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000030632-A1 ARYL AND HETEROARYL COMPOUNDS USEFUL AS FIBROBLAST GROWTH FACTOR ANTAGONISTS EISAI CO., LTD. (JP) 2000-06-02 — — WO claimed
WO-2000030632-A1 ARYL AND HETEROARYL COMPOUNDS USEFUL AS FIBROBLAST GROWTH FACTOR ANTAGONISTS EISAI CO., LTD. (JP) 2000-06-02 — — WO disclosed
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